N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide

C14H20N6O — CID 80843200

IUPACN,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide
SMILESCCCc1c(NC)ncnc1-n1ccc(C(=O)N(C)C)n1
InChIInChI=1S/C14H20N6O/c1-5-6-10-12(15-2)16-9-17-13(10)20-8-7-11(18-20)14(21)19(3)4/h7-9H,5-6H2,1-4H3,(H,15,16,17)
InChIKeyNKLAHNLXPNYNCJ-UHFFFAOYSA-N
MW288.36 g/mol
LogP1.36
Rot. Bonds5

About N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide

N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide (PubChem CID 80843200) has the molecular formula C14H20N6O and a molecular weight of 288.36 g/mol. Its IUPAC name is N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide
PubChem CID80843200
Molecular FormulaC14H20N6O
Molecular Weight288.36 g/mol
Exact Mass288.17
IUPAC NameN,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide
SMILESCCCc1c(NC)ncnc1-n1ccc(C(=O)N(C)C)n1
InChIInChI=1S/C14H20N6O/c1-5-6-10-12(15-2)16-9-17-13(10)20-8-7-11(18-20)14(21)19(3)4/h7-9H,5-6H2,1-4H3,(H,15,16,17)
InChIKeyNKLAHNLXPNYNCJ-UHFFFAOYSA-N
XLogP1.36
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.36
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide?
The IUPAC name of N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide (CID 80843200) is N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide?
The canonical SMILES for N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide is CCCc1c(NC)ncnc1-n1ccc(C(=O)N(C)C)n1.
What is the InChIKey of N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide?
The InChIKey is NKLAHNLXPNYNCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-5-6-10-12(15-2)16-9-17-13(10)20-8-7-11(18-20)14(21)19(3)4/h7-9H,5-6H2,1-4H3,(H,15,16,17).
What are the key properties of N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide?
N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide has a molecular weight of 288.36 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[6-(methylamino)-5-propylpyrimidin-4-yl]pyrazole-3-carboxamide is sourced from PubChem (CID 80843200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).